Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
| ▸ | BACE1 | P56817 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | NPC1 | O15118 | 4/20 | 0.35 |
| ▸ | RAB9A | P51151 | 4/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9868860 | 0.78 | ALOX5 (0.41) | ALOX5ALDH1A1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL9869072 | 0.77 | KDM4E (0.48) | ALOX5BACE1ALDH1A1KDM4EHPGD | |
| SCHEMBL9868772 | 0.68 | ALOX5 (0.46) | ALOX5BACE1ALDH1A1KDM4EHPGD | |
| SCHEMBL9869497 | 0.68 | ALOX5 (0.46) | ALOX5BACE1KDM4ESMN1; SMN2HSD17B10 | |
| SCHEMBL9870371 | 0.67 | KDM4E (0.40) | ALDH1A1KDM4EHPGDMAPTGAA | |
| SCHEMBL10740859 | 0.66 | BACE1 (0.50) | ALOX5BACE1ALDH1A1KDM4EHPGD | |
| SCHEMBL9540920 | 0.64 | MAPT (0.52) | ALDH1A1KDM4EHPGDSMN1; SMN2MAPT | |
| SCHEMBL28760356 | 0.64 | KDM4E (0.54) | ALOX5BACE1ALDH1A1KDM4EHPGD | |
| SCHEMBL28790280 | 0.64 | ALOX5 (0.73) | ALOX5BACE1ALDH1A1KDM4EHPGD | |
| SCHEMBL27803410 | 0.64 | ALOX5 (0.73) | ALOX5BACE1ALDH1A1KDM4EHPGD |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4904672-A | Derivatives of 3-hydroxyazabenzo[b]thiophene useful as 5-lipoxygenase inhibitors | MERCK & CO., INC. (US) | 1990-02-27 | — | — | US | claimed |
| US-5006532-A | Enzyme inhibitor; antiinflammatory agents | MERCK & CO. INC., INC. (US) | 1991-04-09 | — | — | US | disclosed |
| US-4904672-A | Derivatives of 3-hydroxyazabenzo[b]thiophene useful as 5-lipoxygenase inhibitors | MERCK & CO., INC. (US) | 1990-02-27 | — | — | US | disclosed |
| US-4767766-A | Derivatives of 3-hydroxyazabenzo(B)thiophene useful as 5-lipoxygenase inhibitors | MERCK & CO., INC. (US) | 1988-08-30 | — | — | US | disclosed |